UCSF

ZINC38602790

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 31 Yes

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.24 5.92 -46.53 0 7 -1 95 463.532 8
Mid Mid (pH 6-8) 4.24 5.66 -17.96 1 7 0 93 464.54 8

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.